dactolisib (Q4835503)

915019-65-7 (English)

3 October 2016

chemical formula

C₃₀H₂₃N₅O

1 reference

915019-65-7 (English)

3 October 2016

canonical SMILES

CC(C)(C#N)C1=CC=C(C=C1)N2C3=C4C=C(C=CC4=NC=C3N(C2=O)C)C5=CC6=CC=CC=C6N=C5

1 reference

915019-65-7 (English)

World Health Organisation international non-proprietary name

3 October 2016

dactolisib (English)

1 reference

published in

Recommended INN: List 69

publication date

2013

physically interacts with

ATR serine/threonine kinase

1 reference

mechanistic target of rapamycin kinase

17 August 2016

1 reference

Phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit alpha

17 August 2016

1 reference

Phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit delta

17 August 2016

1 reference

Phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit gamma

17 August 2016

1 reference

InChI=1S/C30H23N5O/c1-30(2,18-31)22-9-11-23(12-10-22)35-28-24-15-19(21-14-20-6-4-5-7-25(20)32-16-21)8-13-26(24)33-17-27(28)34(3)29(35)36/h4-17H,1-3H3

17 August 2016

1 reference

Medical Subject Headings

15 March 2018

Dactolisib

0 references

Identifiers

InChI

1 reference

915019-65-7 (English)

3 October 2016

2 references

915019-65-7 (English)

3 October 2016

ChEBI release 2020-09-01

2 references

dactolisib (English)

3 October 2016

https://commonchemistry.cas.org/detail?cas_rn=915019-65-7

10 April 2021

1 reference

Dactolisib (English)

3 October 2016

2 references

915019-65-7 (English)

3 October 2016

Reaxys registry number

12748665

1 reference

dactolisib (English)

3 October 2016

mapping relation type

2 references

dactolisib (English)

3 October 2016

International Chemical Identifier

InChI

InChI=1S/C30H23N5O/c1-30(2,18-31)22-9-11-23(12-10-22)35-28-24-15-19(21-14-20-6-4-5-7-25(20)32-16-21)8-13-26(24)33-17-27(28)34(3)29(35)36/h4-17H,1-3H3

1 reference

DACTOLISIB (English)

3 October 2016

2 references

inferred from InChIKey

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

1 reference

2 references

DSSTOX compound identifier

DTXCID10161090

0 references

NSC number

751249

0 references

World Health Organisation international non-proprietary name numeric ID

9545

1 reference

reference URL

https://mednet-communities.net/inn/db/ViewINN.aspx?i=9545

1 reference

dactolisib (English)

3 October 2016

1 reference

Medical Subject Headings

14 March 2018

1 reference

Human Metabolome Database ID

HMDB0247649

2 references

based on heuristic

inferred from InChIKey

UNII

RUJ6Z9Y0DT

2 references

Global Substance Registration System

UNII

RUJ6Z9Y0DT

DACTOLISIB (English)

3 October 2016